CiteULike: softsimu's Martyna:GJ [12 articles]

	Constrained Isothermal−Isobaric Molecular Dynamics with Full Atomic Virial† [My Copy] The Journal of Physical Chemistry B, Vol. 105, No. 28. (1 July 2001), pp. 6710-6715. by Giovanni Ciccotti, Glenn J. Martyna, Simone Melchionna, Mark E. Tuckerman posted to md by softsimu on 2008-06-27 19:20:00 as
	Structure of Aqueous Proline via Parallel Tempering Molecular Dynamics and Neutron Diffraction [My Copy] J. Phys. Chem. B, Vol. 111, No. 28. (19 July 2007), pp. 8210-8222. by R. Z. Troitzsch, G. J. Martyna, S. E. Mclain, A. K. Soper, J. Crain posted to parallel-tempering proline by softsimu on 2008-06-27 19:19:35 as
	Understanding Modern Molecular Dynamics: Techniques and Applications [My Copy] J. Phys. Chem. B, Vol. 104, No. 2. (20 January 2000), pp. 159-178. by M. E. Tuckerman, G. J. Martyna posted to md by softsimu on 2008-06-27 19:18:36 as
	A Liouville-operator derived measure-preserving integrator for molecular dynamics simulations in the isothermal-isobaric ensemble [My Copy] J. Phys. Math. Gen., Vol. 39, No. 19. (2006), pp. 5629-5651. by M. E. Tuckerman, J. Alejandre, R. Lo?pez-Rendo?n, A. L. Jochim, G. J. Martyna posted to integrators molecular-dynamics by softsimu on 2008-01-19 21:25:34 as
	A unified formalism for many-body polarization and dispersion: The quantum Drude model applied to fluid xenon [My Copy] Chem. Phys. Lett., Vol. 424, No. 4-6. (2006), pp. 409-413. by T. W. Whitfield, G. J. Martyna posted to xenon by softsimu on 2008-01-19 21:24:55 as along with 1 person rice
	A reciprocal space based method for treating long range interactions in ab initio and force-field-based calculations in clusters [My Copy] The Journal of Chemical Physics, Vol. 110, No. 6. (1999), pp. 2810-2821. by Glenn J. Martyna, Mark E. Tuckerman posted to ab-initio ewald-summation force-field by softsimu on 2008-01-19 21:22:46 as along with 1 person charris5
	Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems [My Copy] J. Chem. Phys., Vol. 115, No. 4. (July 2001), pp. 1678-1702. by M. E. Tuckerman, Y. Liu, G. Ciccotti, G. J. Martyna posted to bibtex-import nemd by softsimu on 2007-12-11 21:32:09 as
	Understanding molecular dynamics: Techniques and Applications [My Copy] Journal of Physical Chemistry B, Vol. 104, No. 2. (2000), pp. 159-178. by M. E. Tuckerman, G. J. Martyna posted to bibtex-import by softsimu on 2007-12-11 21:32:09 as
	On the classical statistical mechanics of non-Hamiltonian systems [My Copy] Europhys. Lett., Vol. 45, No. 2. (January 1999), pp. 149-155. by M. E. Tuckerman, C. J. Mundy, G. J. Martyna posted to bibtex-import non-hamiltonian shear systems by softsimu on 2007-12-11 21:32:09 as
	Reversible multiple time scale molecular dynamics [My Copy] J. Chem. Phys., Vol. 97, No. 3. (1992), pp. 1990-2001. by M. Tuckerman, B. J. Berne, G. J. Martyna posted to bibtex-import integrators trotter by softsimu on 2007-12-11 21:31:53 as
	Explicit reversible integrators for extended systems dynamics [My Copy] Mol. Phys., Vol. 87 (1996), pp. 1117-1157. by G. J. Martyna, M. E. Tuckerman, D. J. Tobias, M. L. Klein posted to bibtex-import by softsimu on 2007-12-11 21:31:12 as
	Molecular dynamics studies of the hexagonal mesophase of sodium dodecylsulphate in aqueous solution [My Copy] Mol. Phys., Vol. 95 (1998), pp. 377-384. by S. Bandyopadhyay, M. L. Klein, G. J. Martyna, M. Tarek posted to micelles bibtex-import sds by softsimu on 2007-12-11 21:31:03 as

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